Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4cqq_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): CYS 4.A SG GLN 2.A OE1 no hydrogen 3.354 N/A ASN 10.A N ASN 319.A OD1 no hydrogen 3.202 N/A ASN 10.A ND2 THR 27.A O no hydrogen 3.079 N/A SER 12.A N ASN 10.A OD1 no hydrogen 3.158 N/A SER 12.A OG VAL 26.A O no hydrogen 2.953 N/A SER 12.A OG THR 27.A O no hydrogen 3.563 N/A GLU 14.A N SER 12.A OG no hydrogen 3.427 N/A VAL 16.A N VAL 24.A O no hydrogen 2.915 N/A THR 18.A N GLU 21.A O no hydrogen 2.796 N/A THR 18.A OG1 GLU 21.A O no hydrogen 2.978 N/A GLU 21.A N THR 18.A OG1 no hydrogen 3.086 N/A ASN 23.A N ASP 17.A OD1 no hydrogen 2.843 N/A VAL 24.A N VAL 16.A O no hydrogen 2.938 N/A VAL 26.A N GLU 14.A O no hydrogen 2.876 N/A THR 27.A N LEU 317.A O no hydrogen 2.893 N/A THR 27.A OG1 HIS 28.A ND1 no hydrogen 2.756 N/A HIS 28.A ND1 THR 27.A OG1 no hydrogen 2.756 N/A GLN 30.A N LEU 313.A O no hydrogen 2.846 N/A ILE 32.A N LEU 311.A O no hydrogen 3.120 N/A LEU 33.A N ASP 31.A OD1 no hydrogen 3.116 N/A GLU 34.A N PHE 291.A O no hydrogen 2.689 N/A LYS 35.A NZ ASP 31.A OD2 no hydrogen 3.063 N/A LYS 35.A NZ LEU 33.A O no hydrogen 3.260 N/A THR 36.A N GLU 34.A OE2 no hydrogen 2.741 N/A THR 36.A OG1 GLU 34.A OE2 no hydrogen 2.817 N/A ASN 38.A N ALA 284.A O no hydrogen 3.260 N/A LYS 40.A N ASN 38.A OD1 no hydrogen 3.022 N/A CYS 42.A N TYR 78.A OH no hydrogen 3.181 N/A CYS 42.A N GLN 279.A OE1 no hydrogen 2.859 N/A CYS 42.A SG LYS 40.A O no hydrogen 3.841 N/A ASP 43.A N CYS 274.A O no hydrogen 2.758 N/A LEU 44.A N VAL 47.A O no hydrogen 3.057 N/A ASP 45.A N THR 276.A O no hydrogen 3.012 N/A GLY 46.A N ASN 275.A OD1 no hydrogen 2.989 N/A VAL 47.A N LEU 44.A O no hydrogen 3.170 N/A LEU 50.A N TYR 78.A O no hydrogen 2.902 N/A LEU 52.A N VAL 80.A O no hydrogen 3.094 N/A CYS 55.A N LEU 52.A O no hydrogen 2.919 N/A CYS 55.A SG MET 66.A O no hydrogen 4.038 N/A SER 56.A N ASN 87.A O no hydrogen 3.357 N/A SER 56.A OG ASP 88.A OD1 no hydrogen 2.554 N/A VAL 57.A N GLU 81.A OE2 no hydrogen 3.244 N/A ALA 58.A N TYR 98.A OH no hydrogen 2.877 N/A GLY 59.A N SER 56.A OG no hydrogen 3.147 N/A TRP 60.A N SER 56.A O no hydrogen 2.859 N/A LEU 61.A N VAL 57.A O no hydrogen 2.936 N/A LEU 62.A N ALA 58.A O no hydrogen 2.876 N/A GLY 63.A N GLY 59.A O no hydrogen 3.159 N/A ASN 64.A N GLY 59.A O no hydrogen 2.713 N/A ASN 64.A ND2 ASP 88.A O no hydrogen 2.874 N/A MET 66.A N ASN 64.A OD1 no hydrogen 2.807 N/A CYS 67.A N ASN 64.A O no hydrogen 2.790 N/A PHE 70.A N CYS 67.A O no hydrogen 3.131 N/A ILE 71.A N ASP 68.A O no hydrogen 3.056 N/A TRP 76.A N ASN 109.A O no hydrogen 2.825 N/A SER 77.A N LYS 48.A O no hydrogen 3.395 N/A SER 77.A OG VAL 47.A O no hydrogen 2.649 N/A TYR 78.A OH CYS 42.A O no hydrogen 2.646 N/A ILE 79.A N THR 263.A O no hydrogen 2.848 N/A VAL 80.A N LEU 50.A O no hydrogen 2.818 N/A GLU 81.A N MET 265.A O no hydrogen 2.928 N/A ALA 83.A N GLU 268.A OE2 no hydrogen 3.031 N/A ASN 87.A N ASP 54.A O no hydrogen 3.119 N/A ASP 94.A N MET 226.A O no hydrogen 2.978 N/A ASN 96.A N PHE 228.A O no hydrogen 2.804 N/A LEU 101.A N ASP 97.A O no hydrogen 3.111 N/A LYS 102.A N TYR 98.A O no hydrogen 2.932 N/A LYS 102.A NZ GLU 81.A OE1 no hydrogen 3.515 N/A HIS 103.A N GLU 99.A O no hydrogen 2.860 N/A LEU 104.A N GLU 100.A O no hydrogen 3.190 N/A LEU 105.A N LEU 101.A O no hydrogen 3.147 N/A LEU 105.A N LYS 102.A O no hydrogen 3.016 N/A SER 106.A N HIS 103.A O no hydrogen 3.233 N/A SER 106.A OG HIS 103.A O no hydrogen 2.576 N/A ARG 107.A N LEU 104.A O no hydrogen 3.257 N/A ILE 108.A N LEU 105.A O no hydrogen 3.117 N/A ASN 109.A N LYS 258.A O no hydrogen 3.242 N/A GLU 112.A N LYS 255.A O no hydrogen 2.926 N/A LYS 113.A NZ ILE 71.A O no hydrogen 2.705 N/A ILE 114.A N ALA 253.A O no hydrogen 2.911 N/A ILE 116.A N GLU 251.A O no hydrogen 3.083 N/A ILE 117.A N GLU 251.A O no hydrogen 3.408 N/A SER 121.A N PRO 118.A O no hydrogen 3.074 N/A SER 121.A OG PRO 118.A O no hydrogen 3.163 N/A SER 123.A N SER 121.A O no hydrogen 3.106 N/A HIS 125.A NE2 PRO 158.A O no hydrogen 2.880 N/A GLU 126.A N ILE 151.A O no hydrogen 2.883 N/A SER 128.A N GLU 126.A OE2 no hydrogen 3.040 N/A VAL 131.A N LEU 129.A O no hydrogen 3.032 N/A SER 132.A N SER 142.A O no hydrogen 3.076 N/A ALA 134.A N SER 132.A OG no hydrogen 3.124 N/A CYS 135.A N SER 132.A O no hydrogen 3.239 N/A TYR 137.A N LYS 140.A O no hydrogen 2.756 N/A LYS 140.A N TYR 137.A O no hydrogen 3.208 N/A SER 142.A N CYS 135.A O no hydrogen 2.868 N/A ARG 145.A N GLY 63.A O no hydrogen 2.653 N/A ARG 145.A NE ASP 68.A OD1 no hydrogen 2.801 N/A ARG 145.A NH2 ASP 68.A OD1 no hydrogen 3.562 N/A ARG 145.A NH2 ASP 68.A OD2 no hydrogen 2.976 N/A ASN 146.A N LEU 62.A O no hydrogen 3.236 N/A ASN 146.A ND2 LEU 61.A O no hydrogen 2.714 N/A VAL 148.A N ALA 249.A O no hydrogen 2.638 N/A TRP 149.A NE1 TYR 191.A OH no hydrogen 2.925 N/A ILE 151.A N GLU 126.A O no hydrogen 3.148 N/A LYS 152.A N LEU 190.A O no hydrogen 3.155 N/A LYS 153.A N THR 156.A O no hydrogen 3.116 N/A THR 156.A OG1 ASN 154.A O no hydrogen 3.267 N/A ILE 160.A N SER 243.A O no hydrogen 2.711 N/A ARG 162.A N PHE 241.A O no hydrogen 3.016 N/A SER 163.A OG ILE 239.A O no hydrogen 3.338 N/A SER 163.A OG ASN 240.A OD1 no hydrogen 2.717 N/A TYR 164.A N ILE 239.A O no hydrogen 3.045 N/A ASN 166.A N ASP 237.A O no hydrogen 2.852 N/A ASN 166.A ND2 GLU 170.A O no hydrogen 3.370 N/A ASN 166.A ND2 LEU 233.A O no hydrogen 3.290 N/A ASN 166.A ND2 LYS 234.A O no hydrogen 2.984 N/A ASN 168.A N ASN 166.A OD1 no hydrogen 3.235 N/A ASN 168.A ND2 ASN 166.A OD1 no hydrogen 3.175 N/A LEU 172.A N LEU 233.A O no hydrogen 3.012 N/A LEU 173.A N TYR 254.A O no hydrogen 2.927 N/A VAL 174.A N THR 231.A O no hydrogen 3.069 N/A TRP 176.A N PHE 229.A O no hydrogen 3.147 N/A TRP 176.A NE1 GLN 207.A OE1 no hydrogen 3.221 N/A GLY 177.A N ILE 248.A O no hydrogen 3.029 N/A ILE 178.A N GLU 227.A O no hydrogen 3.086 N/A HIS 179.A N ASN 246.A O no hydrogen 3.015 N/A HIS 179.A ND1 TYR 191.A OH no hydrogen 2.641 N/A HIS 180.A N ARG 225.A O no hydrogen 2.741 N/A HIS 180.A NE2 GLU 227.A OE1 no hydrogen 2.968 N/A ASN 182.A N GLU 186.A OE1 no hydrogen 2.923 N/A GLU 186.A N ASP 183.A O no hydrogen 3.246 N/A GLU 186.A N ASP 183.A OD1 no hydrogen 2.722 N/A GLN 187.A N ASP 183.A O no hydrogen 3.361 N/A GLN 187.A NE2 ASN 193.A O no hydrogen 2.931 N/A GLN 187.A NE2 ASN 246.A OD1 no hydrogen 2.915 N/A THR 188.A OG1 ALA 185.A O no hydrogen 2.821 N/A LYS 189.A N ALA 185.A O no hydrogen 2.935 N/A LEU 190.A N GLU 186.A O no hydrogen 3.049 N/A TYR 191.A N GLN 187.A O no hydrogen 2.833 N/A TYR 191.A OH HIS 179.A ND1 no hydrogen 2.641 N/A ARG 192.A N GLN 187.A O no hydrogen 3.234 N/A ARG 192.A N THR 188.A O no hydrogen 2.861 N/A ASN 193.A N TYR 191.A O no hydrogen 2.734 N/A THR 196.A OG1 ASN 246.A OD1 no hydrogen 2.567 N/A TYR 197.A N ASN 244.A OD1 no hydrogen 2.943 N/A TYR 197.A OH GLU 242.A OE2 no hydrogen 2.679 N/A ILE 198.A N LEU 209.A O no hydrogen 2.925 N/A SER 199.A N GLU 242.A O no hydrogen 2.700 N/A SER 199.A OG GLU 242.A O no hydrogen 3.014 N/A VAL 200.A N GLN 207.A O no hydrogen 3.155 N/A GLY 201.A N ASN 240.A O no hydrogen 3.130 N/A THR 202.A N LEU 205.A O no hydrogen 3.144 N/A SER 203.A N ASP 237.A OD2 no hydrogen 3.095 N/A SER 203.A OG ASP 237.A OD2 no hydrogen 2.640 N/A THR 204.A N THR 202.A OG1 no hydrogen 3.114 N/A THR 204.A OG1 THR 202.A OG1 no hydrogen 3.354 N/A LEU 205.A N THR 202.A OG1 no hydrogen 2.804 N/A GLN 207.A N VAL 200.A O no hydrogen 2.855 N/A LEU 209.A N ILE 198.A O no hydrogen 2.726 N/A ARG 212.A N HIS 180.A ND1 no hydrogen 3.307 N/A ARG 212.A NH2 GLU 227.A OE1 no hydrogen 2.909 N/A ARG 216.A NE ASN 223.A O no hydrogen 3.175 N/A ARG 216.A NH1 ARG 212.A O no hydrogen 3.062 N/A ARG 216.A NH2 PRO 181.A O no hydrogen 2.747 N/A VAL 219.A N GLN 222.A O no hydrogen 3.004 N/A ASN 220.A ND2 CYS 90.A O no hydrogen 3.160 N/A GLN 222.A N VAL 219.A O no hydrogen 3.243 N/A ARG 225.A N HIS 180.A O no hydrogen 3.150 N/A ARG 225.A NH1 GLN 222.A O no hydrogen 3.373 N/A ARG 225.A NH1 GLY 224.A O no hydrogen 3.085 N/A ARG 225.A NH2 SER 217.A O no hydrogen 2.883 N/A MET 226.A N PRO 92.A O no hydrogen 3.007 N/A GLU 227.A N ILE 178.A O no hydrogen 3.028 N/A PHE 228.A N ASP 94.A O no hydrogen 3.013 N/A PHE 229.A N TRP 176.A O no hydrogen 2.906 N/A TRP 230.A NE1 ASP 97.A O no hydrogen 3.258 N/A THR 231.A N VAL 174.A O no hydrogen 3.196 N/A LEU 233.A N LEU 172.A O no hydrogen 2.750 N/A ASN 236.A N ASN 166.A O no hydrogen 2.820 N/A ASP 237.A N LYS 234.A O no hydrogen 3.388 N/A ILE 239.A N TYR 164.A O no hydrogen 2.820 N/A ASN 240.A N GLY 201.A O no hydrogen 2.888 N/A ASN 240.A ND2 GLY 201.A O no hydrogen 3.430 N/A PHE 241.A N ARG 162.A O no hydrogen 2.868 N/A GLU 242.A N SER 199.A O no hydrogen 2.991 N/A SER 243.A N ILE 160.A O no hydrogen 3.162 N/A SER 243.A OG TYR 197.A O no hydrogen 2.552 N/A ASN 244.A ND2 THR 195.A O no hydrogen 3.276 N/A GLY 245.A N SER 243.A OG no hydrogen 3.223 N/A ASN 246.A ND2 HIS 179.A O no hydrogen 2.978 N/A ASN 246.A ND2 GLN 187.A OE1 no hydrogen 2.958 N/A ILE 248.A N GLY 177.A O no hydrogen 2.791 N/A ALA 249.A N VAL 148.A O no hydrogen 2.858 N/A GLU 251.A N ASN 146.A O no hydrogen 2.823 N/A TYR 252.A N ASN 146.A O no hydrogen 3.130 N/A ALA 253.A N ILE 114.A O no hydrogen 2.816 N/A TYR 254.A N LEU 173.A O no hydrogen 3.255 N/A TYR 254.A OH LEU 61.A O no hydrogen 3.058 N/A LYS 255.A N GLU 112.A O no hydrogen 2.793 N/A LYS 255.A NZ ASN 168.A OD1 no hydrogen 3.383 N/A ILE 256.A N ASP 171.A O no hydrogen 3.084 N/A VAL 257.A N HIS 110.A O no hydrogen 3.387 N/A LYS 258.A NZ GLU 75.A OE2 no hydrogen 3.195 N/A LYS 259.A NZ ASP 171.A OD2 no hydrogen 3.102 N/A GLY 260.A N ARG 107.A O no hydrogen 2.940 N/A SER 262.A OG SER 77.A O no hydrogen 3.396 N/A MET 265.A N ILE 79.A O no hydrogen 2.746 N/A SER 267.A N GLU 81.A O no hydrogen 3.246 N/A SER 267.A OG PRO 281.A O no hydrogen 3.035 N/A LEU 269.A N SER 267.A OG no hydrogen 3.140 N/A TYR 271.A OH ASP 43.A OD1 no hydrogen 2.694 N/A TYR 271.A OH ASP 43.A OD2 no hydrogen 3.200 N/A GLY 272.A N LEU 41.A O no hydrogen 2.731 N/A CYS 274.A SG ASN 275.A O no hydrogen 3.787 N/A THR 276.A N ASP 43.A O no hydrogen 2.890 N/A THR 276.A OG1 CYS 278.A O no hydrogen 2.995 N/A CYS 278.A N THR 276.A OG1 no hydrogen 3.187 N/A GLN 279.A N ILE 299.A O no hydrogen 3.000 N/A GLN 279.A NE2 LYS 40.A O no hydrogen 2.794 N/A GLN 279.A NE2 THR 280.A O no hydrogen 3.072 N/A THR 280.A N GLY 283.A O no hydrogen 2.875 N/A THR 280.A OG1 GLY 283.A O no hydrogen 2.645 N/A MET 282.A N THR 280.A OG1 no hydrogen 3.072 N/A GLY 283.A N THR 280.A O no hydrogen 3.109 N/A ALA 284.A N ASN 38.A OD1 no hydrogen 2.928 N/A ILE 285.A N CYS 278.A O no hydrogen 2.872 N/A PHE 291.A N ILE 32.A O no hydrogen 3.189 N/A HIS 292.A N LYS 304.A O no hydrogen 2.890 N/A ASN 293.A N GLU 34.A O no hydrogen 3.273 N/A ASN 293.A ND2 SER 308.A O no hydrogen 2.895 N/A ILE 294.A N HIS 292.A ND1 no hydrogen 3.352 N/A LEU 297.A N HIS 295.A ND1 no hydrogen 3.178 N/A ILE 299.A N GLN 279.A O no hydrogen 3.111 N/A GLU 301.A N LYS 277.A O no hydrogen 3.065 N/A CYS 302.A SG THR 298.A OG1 no hydrogen 3.253 N/A CYS 302.A SG ILE 299.A O no hydrogen 3.697 N/A LYS 304.A N PRO 290.A O no hydrogen 3.048 N/A VAL 306.A N HIS 292.A O no hydrogen 2.936 N/A LEU 313.A N GLN 30.A O no hydrogen 2.987 N/A THR 315.A N HIS 28.A O no hydrogen 3.277 N/A GLY 316.A N HIS 28.A O no hydrogen 2.962 N/A LEU 317.A N THR 27.A OG1 no hydrogen 3.152 N/A ARG 318.A NH2 GLU 21.A OE1 no hydrogen 2.940 N/A ASN 319.A N THR 25.A O no hydrogen 2.864 N/A ASN 319.A ND2 ASN 10.A O no hydrogen 2.793 N/A ASN 319.A ND2 SER 12.A O no hydrogen 3.057 N/A SER 320.A N ASN 319.A OD1 no hydrogen 2.822 N/A